input word = C00064116

Metabolite InformationStructural formula
Name Jaborosalactone D
Formula C28H40O6
Mw 472.28248901
CAS RN 19891-82-8
C_ID C00064116
InChIKey LDWRZKAVHDHGID-VZGLNVPESA-N
InChICode InChI=1S/C28H40O6/c1-15-12-22(34-25(32)18(15)14-29)16(2)19-7-8-20-17-13-24(31)28(33)10-5-6-23(30)27(28,4)21(17)9-11-26(19,20)3/h5-6,16-17,19-22,24,29,31,33H,7-14H2,1-4H3/t16-,17-,19+,20-,21-,22+,24+,26+,27-,28-/m0/s1
SMILES CC1=C(CO)C(=O)OC(C(C)C2CCC3C4CC(O)C5(O)CC=CC(=O)C5(C)C4CCC23C)C1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeSolanaceaeWithania somnifera Ref.
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